Cas no 67579-84-4 (1,2-Cyclohexanediamine, N,N-diethyl-, trans-)
67579-84-4 structure
Product Name:1,2-Cyclohexanediamine, N,N-diethyl-, trans-
CAS No:67579-84-4
MF:C10H22N2
MW:170.295082569122
CID:394594
PubChem ID:28152378
Update Time:2025-04-19
1,2-Cyclohexanediamine, N,N-diethyl-, trans- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Cyclohexanediamine, N,N-diethyl-, trans-
- TRANS-2-(DIETHYLAMINO)-CYCLOHEXYLAMINE
- TRANS-2-AMINOCYCLOHEXYLDIETHYLAMINE
- 67579-84-4
- (1r,2r)-N,N-diethylcyclohexane-1,2-diamine
- trans-N,N-diethyl-1,2-cyclohexanediamine
- SCHEMBL10647257
- VTVCXLUDVDCEBU-NXEZZACHSA-N
- (1R,2R)-2-N,2-N-diethylcyclohexane-1,2-diamine
- (1R,2R)-N1,N1-Diethylcyclohexane-1,2-diamine
-
- Inchi: 1S/C10H22N2/c1-3-12(4-2)10-8-6-5-7-9(10)11/h9-10H,3-8,11H2,1-2H3/t9-,10-/m1/s1
- InChI Key: VTVCXLUDVDCEBU-NXEZZACHSA-N
- SMILES: N(CC)(CC)[C@@H]1CCCC[C@H]1N
Computed Properties
- Exact Mass: 170.17800
- Monoisotopic Mass: 170.178298710g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 121
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.4
- Topological Polar Surface Area: 29.3?2
Experimental Properties
- PSA: 29.26000
- LogP: 2.29840
1,2-Cyclohexanediamine, N,N-diethyl-, trans- Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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